(2S)-2-(1-adamantyl)-2-[(2,4-dichlorophenyl)carbonylamino]ethanoate

Systemtic Name: (2S)-2-(1-adamantyl)-2-[(2,4-dichlorophenyl)carbonylamino]ethanoate Openeye Name: (2S)-2-(1-adamantyl)-2-[(2,4-dichlorobenzoyl)amino]acetate CAS Name: (2S)-2-(1-adamantyl)-2-[[(2,4-dichlorophenyl)-oxomethyl]amino]acetate IUPAC Name: (2S)-2-(1-adamantyl)-2-[(2,4-dichlorobenzoyl)amino]acetate Traditional Name: (2S)-2-(1-adamantyl)-2-[(2,4-dichlorobenzoyl)amino]acetate Formula: C19H20Cl2NO3- MolecularWeight: 381.273

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(C(=O)[O-])NC(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[C@@H](C(=O)[O-])NC(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C19H21Cl2NO3/c20-13-1-2-14(15(21)6-13)17(23)22-16(18(24)25)19-7-10-3-11(8-19)5-12(4-10)9-19/h1-2,6,10-12,16H,3-5,7-9H2,(H,22,23)(H,24,25)/p-1/t10?,11?,12?,16-,19?/m1/s1